Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5815006

CC(C)(C)OC(=O)N1CCCC1CNCc1cc2ccccc2o1.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 2/20 0.47
ADAM10 O14672 1/20 0.47
MMP1 P03956 1/20 0.47
MMP2 P08253 1/20 0.47
MMP3 P08254 1/20 0.47
MMP14 P50281 1/20 0.47
ADAM17 P78536 1/20 0.47
OPRD1 P41143 1/20 0.42
METTL3 Q86U44 1/20 0.42
PREP P48147 1/20 0.42
KDM1A O60341 1/20 0.41
PDE7B Q9NP56 1/20 0.40
EPHX2 P34913 1/20 0.40
ALDH1A1 P00352 2/20 0.40
PRMT5 O14744 1/20 0.39
APP P05067 1/20 0.38
HTR1A P08908 1/20 0.38
ADRA2A P08913 1/20 0.38
DRD2 P14416 1/20 0.38
ADRA2B P18089 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Trifluoroacetic Acid SCHEMBL5100039 1.00 MMP13 (0.47) MMP13ADAM10MMP1MMP2MMP3
SCHEMBL3506148 0.95 MMP13 (0.49) MMP13ADAM10MMP1MMP2MMP3
SCHEMBL3506151 0.95 MMP13 (0.49) MMP13ADAM10MMP1MMP2MMP3
Trifluoroacetic Acid SCHEMBL5093630 0.84 MMP13 (0.42) MMP13ADAM10MMP1MMP2MMP3
SCHEMBL4585745 0.82 ADAM10 (0.54) MMP13ADAM10MMP1MMP2MMP3
SCHEMBL14138680 0.81 ADAM10 (0.46) MMP13ADAM10MMP1MMP2MMP3
SCHEMBL1682323 0.79 OPRD1 (0.52) OPRD1METTL3KDM1AALDH1A1PRMT5
SCHEMBL25650104 0.79 OPRD1 (0.52) OPRD1METTL3KDM1AALDH1A1PRMT5
SCHEMBL5100293 0.78 MMP13 (0.44) MMP13ADAM10MMP1MMP2MMP3
SCHEMBL5100301 0.78 METTL3 (0.52) OPRD1METTL3KDM1APDE7BALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006038989-A1 SUBSTITUTED ARYLAMIDES CHEMOCENTRYX, INC. (US) 2006-04-13 WO disclosed